Drug Information

Drug ID:  NPD1677
Drug Name:  lanperisone
Molecular Formula:  C15H18F3NO
Canonical SMILES:  C[C@@H](C(=O)c1ccc(cc1)C(F)(F)F)CN1CCCC1
Standard InCHI:  InChI=1S/C15H18F3NO/c1-11(10-19-8-2-3-9-19)14(20)12-4-6-13(7-5-12)15(16,17)18/h4-7,11H,2-3,8-10H2,1H3/t11-/m1/s1
Standard InCHIKey:  RYZCWZZJFAKYHX-LLVKDONJSA-N
Max Developmental Stage:  Discontinued
Max Developmental Stage Source:  TTD

  Structural Similarity Between NPASS Natural Products and NPD1677

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient
Tanimoto coefficient is calculated based on PubChem 881-bit substructure fingerprints.


  Similar Natural Products

High Similarity Level: Tc>=0.85; Intermediate Similarity Level: 0.7 <= Tc < 0.85; Remote Similarity Level: 0.65 <= Tc < 0.7

Similarity Level Similarity Score Natural Product ID
Intermediate Similarity 0.8131 NPC167336
Intermediate Similarity 0.7732 NPC145053
Intermediate Similarity 0.7629 NPC190567
Intermediate Similarity 0.7524 NPC246757
Intermediate Similarity 0.7524 NPC291070
Intermediate Similarity 0.7451 NPC69057
Intermediate Similarity 0.7449 NPC285716
Intermediate Similarity 0.7449 NPC17408
Intermediate Similarity 0.7423 NPC36342
Intermediate Similarity 0.7423 NPC2785
Intermediate Similarity 0.7423 NPC285470
Intermediate Similarity 0.7353 NPC160339
Intermediate Similarity 0.7353 NPC307
Intermediate Similarity 0.7347 NPC300205
Intermediate Similarity 0.7345 NPC55529
Intermediate Similarity 0.7333 NPC133461
Intermediate Similarity 0.732 NPC245966
Intermediate Similarity 0.729 NPC256452
Intermediate Similarity 0.7273 NPC164086
Intermediate Similarity 0.7264 NPC153885
Intermediate Similarity 0.7255 NPC252067
Intermediate Similarity 0.7245 NPC103488
Intermediate Similarity 0.7228 NPC197581
Intermediate Similarity 0.72 NPC12936
Intermediate Similarity 0.72 NPC273033
Intermediate Similarity 0.7196 NPC238219
Intermediate Similarity 0.713 NPC260233
Intermediate Similarity 0.7103 NPC1682
Intermediate Similarity 0.7103 NPC188844
Intermediate Similarity 0.7103 NPC323420
Intermediate Similarity 0.7103 NPC155232
Intermediate Similarity 0.71 NPC71664
Intermediate Similarity 0.7075 NPC58872
Intermediate Similarity 0.7075 NPC173413
Intermediate Similarity 0.7075 NPC277277
Intermediate Similarity 0.7064 NPC219573
Intermediate Similarity 0.7064 NPC185208
Intermediate Similarity 0.7059 NPC273758
Intermediate Similarity 0.7059 NPC113099
Intermediate Similarity 0.7048 NPC157778
Intermediate Similarity 0.7037 NPC474974
Intermediate Similarity 0.703 NPC231986
Intermediate Similarity 0.703 NPC100039
Intermediate Similarity 0.7009 NPC284475
Intermediate Similarity 0.7 NPC239185
Remote Similarity 0.6952 NPC305602
Remote Similarity 0.6952 NPC43945
Remote Similarity 0.6952 NPC17497
Remote Similarity 0.6944 NPC59677
Remote Similarity 0.6937 NPC75724
Remote Similarity 0.6937 NPC49994
Remote Similarity 0.6937 NPC134882
Remote Similarity 0.6911 NPC177684
Remote Similarity 0.6911 NPC291962
Remote Similarity 0.6907 NPC285679
Remote Similarity 0.6905 NPC285394
Remote Similarity 0.6887 NPC267262
Remote Similarity 0.6887 NPC153308
Remote Similarity 0.6881 NPC71140
Remote Similarity 0.6881 NPC289883
Remote Similarity 0.688 NPC26285
Remote Similarity 0.6863 NPC73978
Remote Similarity 0.6855 NPC258531
Remote Similarity 0.6855 NPC112373
Remote Similarity 0.6855 NPC27833
Remote Similarity 0.6855 NPC161956
Remote Similarity 0.685 NPC79698
Remote Similarity 0.6847 NPC265220
Remote Similarity 0.6832 NPC139901
Remote Similarity 0.6832 NPC151405
Remote Similarity 0.6822 NPC113307
Remote Similarity 0.6814 NPC476993
Remote Similarity 0.6814 NPC109514
Remote Similarity 0.6804 NPC74458
Remote Similarity 0.6794 NPC473962
Remote Similarity 0.6789 NPC473661
Remote Similarity 0.6786 NPC322598
Remote Similarity 0.6774 NPC226143
Remote Similarity 0.6765 NPC157055
Remote Similarity 0.6765 NPC95868
Remote Similarity 0.6759 NPC19256
Remote Similarity 0.6744 NPC305717
Remote Similarity 0.6733 NPC137847
Remote Similarity 0.6733 NPC76455
Remote Similarity 0.6731 NPC324624
Remote Similarity 0.6731 NPC215008
Remote Similarity 0.6731 NPC39600
Remote Similarity 0.6731 NPC149263
Remote Similarity 0.6701 NPC95289
Remote Similarity 0.6698 NPC164526
Remote Similarity 0.6696 NPC247976
Remote Similarity 0.6667 NPC281104
Remote Similarity 0.6667 NPC181390
Remote Similarity 0.6667 NPC257490
Remote Similarity 0.6667 NPC418308
Remote Similarity 0.6639 NPC158854
Remote Similarity 0.6635 NPC230068
Remote Similarity 0.6634 NPC9796
Remote Similarity 0.6634 NPC329318
Remote Similarity 0.6614 NPC291027
Remote Similarity 0.6614 NPC213126
Remote Similarity 0.6614 NPC84281
Remote Similarity 0.6614 NPC317474
Remote Similarity 0.6614 NPC169485
Remote Similarity 0.661 NPC172170
Remote Similarity 0.6602 NPC477703
Remote Similarity 0.6598 NPC98880
Remote Similarity 0.6591 NPC126458
Remote Similarity 0.6589 NPC470343
Remote Similarity 0.6589 NPC472244
Remote Similarity 0.6585 NPC473573
Remote Similarity 0.6581 NPC143516
Remote Similarity 0.6581 NPC473418
Remote Similarity 0.6574 NPC473345
Remote Similarity 0.6552 NPC472691
Remote Similarity 0.6552 NPC471829
Remote Similarity 0.6552 NPC475939
Remote Similarity 0.6552 NPC474866
Remote Similarity 0.6552 NPC202613
Remote Similarity 0.6549 NPC472258
Remote Similarity 0.6545 NPC103346
Remote Similarity 0.6535 NPC78500
Remote Similarity 0.6525 NPC474973
Remote Similarity 0.6525 NPC100767
Remote Similarity 0.6525 NPC472699
Remote Similarity 0.6525 NPC474804
Remote Similarity 0.6525 NPC130898
Remote Similarity 0.6525 NPC45033
Remote Similarity 0.6525 NPC472700
Remote Similarity 0.6522 NPC472879
Remote Similarity 0.6522 NPC473325
Remote Similarity 0.6518 NPC472880
Remote Similarity 0.6514 NPC298115
Remote Similarity 0.6505 NPC272260
Remote Similarity 0.6496 NPC329282
Remote Similarity 0.6495 NPC311343
Remote Similarity 0.6471 NPC472683
Remote Similarity 0.6471 NPC472695
Remote Similarity 0.6471 NPC472696
Remote Similarity 0.6471 NPC472701
Remote Similarity 0.6471 NPC298023
Remote Similarity 0.6466 NPC25458
Remote Similarity 0.6457 NPC279385
Remote Similarity 0.6457 NPC179605
Remote Similarity 0.6455 NPC67585
Remote Similarity 0.6455 NPC110420
Remote Similarity 0.6455 NPC303967
Remote Similarity 0.6441 NPC476198
Remote Similarity 0.6439 NPC150863
Remote Similarity 0.6423 NPC57051
Remote Similarity 0.6417 NPC470252
Remote Similarity 0.6417 NPC473676
Remote Similarity 0.6415 NPC474088
Remote Similarity 0.6412 NPC119326
Remote Similarity 0.641 NPC471317
Remote Similarity 0.6406 NPC103292
Remote Similarity 0.6404 NPC240042
Remote Similarity 0.6391 NPC179224
Remote Similarity 0.6391 NPC280807
Remote Similarity 0.6391 NPC472245
Remote Similarity 0.6391 NPC314431
Remote Similarity 0.6387 NPC37914
Remote Similarity 0.6387 NPC185763
Remote Similarity 0.6387 NPC83409
Remote Similarity 0.6383 NPC297322
Remote Similarity 0.6373 NPC271642
Remote Similarity 0.6371 NPC472164
Remote Similarity 0.6371 NPC246904
Remote Similarity 0.6364 NPC325709
Remote Similarity 0.6357 NPC39818
Remote Similarity 0.6337 NPC208075
Remote Similarity 0.6328 NPC200964
Remote Similarity 0.6325 NPC304873
Remote Similarity 0.6324 NPC162417
Remote Similarity 0.6324 NPC316104
Remote Similarity 0.632 NPC188010
Remote Similarity 0.6311 NPC179726
Remote Similarity 0.6311 NPC474057
Remote Similarity 0.6311 NPC265513
Remote Similarity 0.6308 NPC254698
Remote Similarity 0.6306 NPC274455
Remote Similarity 0.6306 NPC86670
Remote Similarity 0.6306 NPC70940
Remote Similarity 0.6306 NPC84288
Remote Similarity 0.6303 NPC474910
Remote Similarity 0.6303 NPC172483
Remote Similarity 0.6296 NPC123476
Remote Similarity 0.6293 NPC217621
Remote Similarity 0.6275 NPC98976
Remote Similarity 0.6275 NPC276699
Remote Similarity 0.6271 NPC329556
Remote Similarity 0.6271 NPC274443
Remote Similarity 0.627 NPC285926
Remote Similarity 0.627 NPC315276
Remote Similarity 0.627 NPC14672
Remote Similarity 0.6269 NPC69496
Remote Similarity 0.626 NPC292834
Remote Similarity 0.626 NPC280789
Remote Similarity 0.625 NPC110704
Remote Similarity 0.625 NPC471447

Drug Structure

External Identifiers

TTD   DIB000581
DrugBank  
ChEMBL  
IUPHAR/BPS  
PharmaGKB  
KEGG Drug  
PubChem CID  
ChEBI  
CAS Number  

Drug Properties

Molecular Weight  285.13
ALogP  0.6011
MLogP  2.56
XLogP  3.894
HDA  2
HBD  0
Rotatable Bonds  9
TPSA  20.31
RO5 Violation  0